2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3,4-oxadiazole

Systemtic Name: 2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3,4-oxadiazole Openeye Name: 2-(5-methyl-3-phenyl-isoxazol-4-yl)-5-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanylmethyl]-1,3,4-oxadiazole CAS Name: 2-(5-methyl-3-phenyl-4-isoxazolyl)-5-[[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]methyl]-1,3,4-oxadiazole IUPAC Name: 2-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3,4-oxadiazole Traditional Name: 2-(5-methyl-3-phenyl-isoxazol-4-yl)-5-[[(5-pyrrolidinosulfonyl-2-pyridyl)thio]methyl]-1,3,4-oxadiazole Formula: C22H21N5O4S2 MolecularWeight: 483.56324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C3=NN=C(O3)CSC4=NC=C(C=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C3=NN=C(O3)CSC4=NC=C(C=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C22H21N5O4S2/c1-15-20(21(26-31-15)16-7-3-2-4-8-16)22-25-24-18(30-22)14-32-19-10-9-17(13-23-19)33(28,29)27-11-5-6-12-27/h2-4,7-10,13H,5-6,11-12,14H2,1H3